SCHEMBL6767696

SCHEMBL6767696

CS(=O)(=O)CCc1ccc2[nH]c(=O)[nH]c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.53
PKM P14618 2/20 0.53
PTGS2 P35354 1/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 3/20 0.43
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
POLB P06746 1/20 0.41
MEN1 O00255 2/20 0.40
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
GRIA1 P42261 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6766764 0.85 PKM (0.51) GAAPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL6767844 0.83 GAA (0.56) GAAPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL6763586 0.83 PKM (0.49) GAAPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL13303940 0.82 GAA (0.68) GAAPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL5393113 0.79 GAA (0.59) GAAPKMALDH1A1MAPTSMN1; SMN2
SCHEMBL6910223 0.75 GAA (0.59) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL6768064 0.75 GAA (0.59) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL28624153 0.75 GAA (0.70) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL6768001 0.75 GAA (0.65) GAAPKMALDH1A1MAPTKMT2A
SCHEMBL1824734 0.75 GAA (0.54) GAAPKMALDH1A1MAPTSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6699880-B1 STIMULATE MUSCARINIC ACETYLCHOLINE RECEPTORS M4, ANALGESICS BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-03-02 US disclosed
EP-1221443-A1 SUBSTITUTED IMIDAZOLIDINONE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-07-10 EP disclosed